Furan-3-boronic acid
An aromatic compound, C4H5BO3, 111.893 g/mol.
Identifiers
- Molecular formula
- C₄H₅BO₃
- Molecular weight
- 111.893 g/mol
- Exact mass
- 112.033174 g/mol
- IUPAC name
- furan-3-ylboronic acid
- OB(O)c1ccoc1
- InChI=1S/C4H5BO3/c6-5(7)4-1-2-8-3-4/h1-3,6-7H
- CYEFKCRAAGLNHW-UHFFFAOYSA-N
Calculated properties
- Molecular weight
- 111.89 g/mol
- Exact mass
- 112.0331742 Da
- Polar surface area
- 53.6 Ų
- Complexity
- 75
- H-bond donors
- 2
- H-bond acceptors
- 3
- logP
- -1.0406
- Topological polar surface area
- 53.6 Ų
- H-bond donors
- 2
- H-bond acceptors
- 3
- Rotatable bonds
- 1
- Molar refractivity
- 28.5336 cm³/mol
- Fraction sp³ carbons
- 0
- QED drug-likeness
- 0.4559
What it is made of
Structure
- Heavy atoms, hydrogen excluded
- 8
- Total atoms, hydrogen included
- 13
- Rings
- 1
- Aromatic rings
- 1
- Stereocentres
- 0
- Formal charge
- 0
Functional groups
Aromatic ring (five-membered)
The molecule in three dimensions
The drawing above is a diagram of what is bonded to what. A molecule is not flat, and the model here is one low-energy shape generated from the connectivity — useful for seeing which groups can reach each other, and not a measured structure. A real sample is a population of conformations, interconverting.
Reactions it appears in
Other names for it
The systematic name on this record is furan-3-ylboronic acid.
The sources also call it DTXSID30370248, RefChem:345840, DTXCID20321284, 3-Furanboronic acid, furan-3-ylboronic acid, 3-furylboronic Acid, 3-Furanylboronic Acid, (furan-3-yl)boronic acid, MFCD01319007, furan-3-yl-boronic acid, 3-furanyl boronic acid.
Structurally related
Seen alongside it in reaction records
Molecules that appear in the same recorded reactions as Furan-3-boronic acid. This says nothing about structure: most of them are the bases, solvents, ligands and catalysts the chemistry needed, and they are here because somebody put them in the same flask.
1,2-Dimethoxyethane
used as a reactant
C₄H₁₀O₂, 90.122 g/mol.
1,4-Dioxane
used as a reactant
C₄H₈O₂, 88.106 g/mol.
(2',4',6'-Triisopropylbiphenyl-2-yl)phosphine
used as a reactant
C₂₁H₂₉P, 312.437 g/mol.
(1SR,2SR)-2-[3-(2-Furan-3-yl-pyridin-4-yl)-imidazo[1,2-a]pyridin-6-ylamino]-cyclohexanol
formed as a product
C₂₂H₂₂N₄O₂, 374.444 g/mol.
(1SR,2SR)-2-[3-(2-Chloro-pyridin-4-yl)-imidazo[1,2-a]pyridin-6-ylamino]-cyclohexanol
used as a reactant
C₁₈H₁₉ClN₄O, 342.83 g/mol.
Where these values came from
reference compound database2734358
chemistry engine
What this page does not claim
Identifiers are copied from the source record, measured values are reported as published, and calculated values are marked as calculated. Nothing here is a hazard, purity or handling assessment — how the library is checked.
Where to next
More molecules under F
The rest of this shelf, a hundred names at a time.
Molar mass calculator
Work with C4H5BO3 in a calculation, with every element's contribution shown.
Molarity calculator
Grams of Furan-3-boronic acid for a volume and a concentration, or the concentration a mass gives.
Open in ReactionLens
The full record in the workstation: every atom, every bond, and the reactions it appears in.